N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide

C15H17N3O3 — CID 131936035

IUPACN-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide
SMILESO=C(NC1CCCN(C(=O)c2ccco2)C1)c1ccc[nH]1
InChIInChI=1S/C15H17N3O3/c19-14(12-5-1-7-16-12)17-11-4-2-8-18(10-11)15(20)13-6-3-9-21-13/h1,3,5-7,9,11,16H,2,4,8,10H2,(H,17,19)
InChIKeyOCJOTMQATZGCQV-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.64
Rot. Bonds3

About N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide

N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide (PubChem CID 131936035) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound NameN-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide
PubChem CID131936035
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide
SMILESO=C(NC1CCCN(C(=O)c2ccco2)C1)c1ccc[nH]1
InChIInChI=1S/C15H17N3O3/c19-14(12-5-1-7-16-12)17-11-4-2-8-18(10-11)15(20)13-6-3-9-21-13/h1,3,5-7,9,11,16H,2,4,8,10H2,(H,17,19)
InChIKeyOCJOTMQATZGCQV-UHFFFAOYSA-N
XLogP1.64
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopropyl-N-[(3S)-1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrazole-3-carboxamide
CID 95221445
[4-(furan-2-carbonyl)-1,4-diazepan-1-yl]-(1H-pyrrol-2-yl)methanone
CID 110807785
N-[2-[[1-(furan-2-carbonyl)piperidin-3-yl]carbamoyl]phenyl]-2-methylfuran-3-carboxamide
CID 131907567
N-[(3R)-1-(furan-2-carbonyl)piperidin-3-yl]-2,3-dimethyl-1H-indole-7-carboxamide
CID 97433741
N-[1-(furan-2-carbonyl)piperidin-3-yl]azepane-1-sulfonamide
CID 131927041
(3-chloropiperidin-1-yl)-(furan-2-yl)methanone
CID 63392823
N-[1-(furan-2-carbonyl)piperidin-3-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 131939712
N-[1-(furan-2-carbonyl)piperidin-3-yl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide
CID 131942294
N-[1-(furan-2-carbonyl)piperidin-3-yl]-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 91829889
[(3R)-3-(3-azaspiro[5.5]undecan-9-ylamino)piperidin-1-yl]-(furan-2-yl)methanone
CID 95228253
N-[1-(furan-2-carbonyl)piperidin-3-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 74247026
[3-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]-(furan-2-yl)methanone
CID 134697643

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide?
The IUPAC name of N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide (CID 131936035) is N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide.
What is the SMILES notation for N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide?
The canonical SMILES for N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide is O=C(NC1CCCN(C(=O)c2ccco2)C1)c1ccc[nH]1.
What is the InChIKey of N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide?
The InChIKey is OCJOTMQATZGCQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c19-14(12-5-1-7-16-12)17-11-4-2-8-18(10-11)15(20)13-6-3-9-21-13/h1,3,5-7,9,11,16H,2,4,8,10H2,(H,17,19).
What are the key properties of N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide?
N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 131936035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).